1-(diethylamino)-3-[2-(2-methylphenoxy)phenoxy]propan-2-ol hydrate dihydrochloride

Systemtic Name: 1-(diethylamino)-3-[2-(2-methylphenoxy)phenoxy]propan-2-ol hydrate dihydrochloride Openeye Name: 1-(diethylamino)-3-[2-(2-methylphenoxy)phenoxy]propan-2-ol hydrate dihydrochloride CAS Name: 1-(diethylamino)-3-[2-(2-methylphenoxy)phenoxy]-2-propanol hydrate dihydrochloride IUPAC Name: 1-(diethylamino)-3-[2-(2-methylphenoxy)phenoxy]propan-2-ol hydrate dihydrochloride Traditional Name: 1-(diethylamino)-3-[2-(2-methylphenoxy)phenoxy]propan-2-ol hydrate dihydrochloride Formula: C40H58Cl2N2O7 MolecularWeight: 749.80372

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(COC1=CC=CC=C1OC2=CC=CC=C2C)O.CCN(CC)CC(COC1=CC=CC=C1OC2=CC=CC=C2C)O.O.Cl.Cl

Isomeric SMILES

CCN(CC)CC(COC1=CC=CC=C1OC2=CC=CC=C2C)O.CCN(CC)CC(COC1=CC=CC=C1OC2=CC=CC=C2C)O.O.Cl.Cl

InChI

InChI=1S/2C20H27NO3.2ClH.H2O/c2*1-4-21(5-2)14-17(22)15-23-19-12-8-9-13-20(19)24-18-11-7-6-10-16(18)3;;;/h2*6-13,17,22H,4-5,14-15H2,1-3H3;2*1H;1H2